Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 4/20 | 0.52 |
| ▸ | ADH1A | P07327 | 4/20 | 0.52 |
| ▸ | ADH1C | P00326 | 3/20 | 0.52 |
| ▸ | ADH7 | P40394 | 2/20 | 0.52 |
| ▸ | ADH4 | P08319 | 1/20 | 0.50 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL15129522 | 0.88 | ADH1B (0.48) | ADH1BADH1AADH1CADH7ADH4 | |
| SCHEMBL359706 | 0.78 | — | — | |
| SCHEMBL22997842 | 0.75 | ALDH1A1 (0.52) | ADH1BADH1AADH1CADH7ADH4 | |
| SCHEMBL4912168 | 0.74 | ADH1B (0.59) | ADH1BADH1AADH1CADH7ADH4 | |
| SCHEMBL22430868 | 0.74 | — | — | |
| SCHEMBL18925570 | 0.72 | MAPK8 (0.32) | MAPK8 | |
| SCHEMBL25865746 | 0.72 | MAPK8 (0.32) | MAPK8 | |
| SCHEMBL104840 | 0.71 | MAPK8 (0.31) | MAPK8 | |
| Hydrochloric Acid SCHEMBL17311101 | 0.71 | MAPK8 (0.31) | MAPK8 | |
| SCHEMBL16893232 | 0.71 | EPHX1 (0.34) | MAPK8 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2158198-A2 | NOVEL N- (8HETEROARYLTETRAHYDRONAPHTALENE-2YL) OR N- (5- HETEROARYLCHROMANE-3-YL) CARBOXAMIDE DERIVATIVES FOR THE TREATMENT OF PAIN | AstraZeneca AB (SE) | 2010-03-03 | — | — | EP | disclosed |
| WO-2008130320-A2 | NOVEL N- (8-HETEROARYLTETRAHYDRONAPHTALENE-2YL) OR N- (5- HETEROARYLCHROMANE-3-YL) CARBOXAMIDE DERIVATIVES FOR THE TREATMENT OF PAIN | ASTRAZENECA AB (SE) | 2008-10-30 | — | — | WO | disclosed |